methyl 2-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-phenethyl-sulfamoyl]benzoate

Systemtic Name: methyl 2-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl-phenethyl-sulfamoyl]benzoate Openeye Name: methyl 2-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl-phenethyl-sulfamoyl]benzoate CAS Name: 2-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl-phenethylsulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl-phenethylsulfamoyl]benzoate Traditional Name: 2-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl-phenethyl-sulfamoyl]benzoic acid methyl ester Formula: C27H26N2O5S MolecularWeight: 490.57074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C(=O)OC

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CCC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C27H26N2O5S/c1-19-9-8-12-21-17-22(26(30)28-25(19)21)18-29(16-15-20-10-4-3-5-11-20)35(32,33)24-14-7-6-13-23(24)27(31)34-2/h3-14,17H,15-16,18H2,1-2H3,(H,28,30)